1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine

C15H25N3O — CID 116954977

IUPAC1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine
SMILESCNC(CCN1CCNCC1)c1cccc(OC)c1
InChIInChI=1S/C15H25N3O/c1-16-15(6-9-18-10-7-17-8-11-18)13-4-3-5-14(12-13)19-2/h3-5,12,15-17H,6-11H2,1-2H3
InChIKeyNUPFNJPTPYOJIN-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.25
Rot. Bonds6

About 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine

1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine (PubChem CID 116954977) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine
PubChem CID116954977
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine
SMILESCNC(CCN1CCNCC1)c1cccc(OC)c1
InChIInChI=1S/C15H25N3O/c1-16-15(6-9-18-10-7-17-8-11-18)13-4-3-5-14(12-13)19-2/h3-5,12,15-17H,6-11H2,1-2H3
InChIKeyNUPFNJPTPYOJIN-UHFFFAOYSA-N
XLogP1.25
TPSA36.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2S)-2-fluoro-2-(3-methoxyphenyl)ethyl]piperazine
CID 129493110
1-(4-ethylphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine
CID 116954950
(3-methoxyphenyl)-piperazin-1-ylmethanamine
CID 116939833
N-methyl-3-piperazin-1-yl-1-thiophen-2-ylpropan-1-amine
CID 116954947
2-(3-ethyl-4-methylpiperazin-1-yl)-1-(3-methoxyphenyl)-N-methylethanamine
CID 63611052
1-(3-methoxyphenyl)-N-methyloctan-1-amine
CID 62606041
1-(3-bromophenyl)-N-methyl-3-piperidin-1-ylpropan-1-amine
CID 62618370
1-[(1S)-2-fluoro-1-(3-methoxyphenyl)ethyl]piperazine;hydrochloride
CID 171181679
1-[4-(3-methoxyphenyl)butyl]piperazine
CID 94267853
1-(2,5-dimethoxyphenyl)-3-piperazin-1-ylpropan-1-ol
CID 82093877
1-(3-bromophenyl)-3-(4-methoxypiperidin-1-yl)-N-methylpropan-1-amine
CID 62618049
1-(3-bromophenyl)-3-(4-ethylpiperazin-1-yl)-N-methylpropan-1-amine
CID 62612497

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine?
The IUPAC name of 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine (CID 116954977) is 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine.
What is the SMILES notation for 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine?
The canonical SMILES for 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine is CNC(CCN1CCNCC1)c1cccc(OC)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine?
The InChIKey is NUPFNJPTPYOJIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-16-15(6-9-18-10-7-17-8-11-18)13-4-3-5-14(12-13)19-2/h3-5,12,15-17H,6-11H2,1-2H3.
What are the key properties of 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine?
1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 1.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-N-methyl-3-piperazin-1-ylpropan-1-amine is sourced from PubChem (CID 116954977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).